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Home > Fluorides > 1443349-12-9
1443349-12-9 | 3-(3-iso-Butoxy-5-fluorophenyl)-1-propene
CAS No: 1443349-12-9 Catalog No: AG01FBOU MDL No:
Product Description
Catalog Number:
AG01FBOU
Chemical Name:
3-(3-iso-Butoxy-5-fluorophenyl)-1-propene
CAS Number:
1443349-12-9
Molecular Formula:
C13H17FO
Molecular Weight:
208.2719
IUPAC Name:
1-fluoro-3-(2-methylpropoxy)-5-prop-2-enylbenzene
InChI:
InChI=1S/C13H17FO/c1-4-5-11-6-12(14)8-13(7-11)15-9-10(2)3/h4,6-8,10H,1,5,9H2,2-3H3
InChI Key:
IVOZMBQLJHCOIR-UHFFFAOYSA-N
SMILES:
C=CCc1cc(OCC(C)C)cc(c1)F
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.276g/mol
Monoisotopic Mass:
208.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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